1-(2-{(2E)-2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-5-nitrobenzene-1-sulfonyl)-2,4-dimethylpiperidine
Chemical Structure Depiction of
1-(2-{(2E)-2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-5-nitrobenzene-1-sulfonyl)-2,4-dimethylpiperidine
1-(2-{(2E)-2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-5-nitrobenzene-1-sulfonyl)-2,4-dimethylpiperidine
Compound characteristics
| Compound ID: | 8008-8296 |
| Compound Name: | 1-(2-{(2E)-2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-5-nitrobenzene-1-sulfonyl)-2,4-dimethylpiperidine |
| Molecular Weight: | 460.51 |
| Molecular Formula: | C21 H24 N4 O6 S |
| Smiles: | CC1CCN(C(C)C1)S(c1cc(ccc1N/N=C/c1ccc2c(c1)OCO2)[N+]([O-])=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6595 |
| logD: | 4.6595 |
| logSw: | -4.4378 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.947 |
| InChI Key: | YMIHJQITXUXBHY-UHFFFAOYSA-N |